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2-(3-Acetylaminophenoxymethyl)-4-nitrobenzoic acid methyl ester
SpectraBase Compound ID Ju1wBJD5hqi
InChI InChI=1S/C17H16N2O6/c1-11(20)18-13-4-3-5-15(9-13)25-10-12-8-14(19(22)23)6-7-16(12)17(21)24-2/h3-9H,10H2,1-2H3,(H,18,20)
InChIKey QKNXDPYLQWZVEU-UHFFFAOYSA-N
Mol Weight 344.32 g/mol
Molecular Formula C17H16N2O6
Exact Mass 344.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KIcw7NzELDP
Name 2-(3-Acetylaminophenoxymethyl)-4-nitrobenzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O6
InChI InChI=1S/C17H16N2O6/c1-11(20)18-13-4-3-5-15(9-13)25-10-12-8-14(19(22)23)6-7-16(12)17(21)24-2/h3-9H,10H2,1-2H3,(H,18,20)
InChIKey QKNXDPYLQWZVEU-UHFFFAOYSA-N
Instrument Name Hewlett Packard HP 5973
Ionization Type EI
Molecular Weight 344.323 g/mol
SMILES N(C(C)=O)c1cc(ccc1)OCc1c(ccc(c1)[N+](=O)[O-])C(OC)=O
SPLASH splash10-0006-0901000000-839965046979423b3dbd
Source of Spectrum WO2010040843A2
Wiley ID 1842802